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2-[2-[(tert-Butoxycarbonyl)aminophenyl]-5-methoxy-1,4-naphthoquinone
SpectraBase Compound ID LfiZqPeCCZV
InChI InChI=1S/C22H21NO5/c1-22(2,3)28-21(26)23-16-10-6-5-8-13(16)15-12-17(24)19-14(20(15)25)9-7-11-18(19)27-4/h5-12H,1-4H3,(H,23,26)
InChIKey JSVNJYZWMMROFF-UHFFFAOYSA-N
Mol Weight 379.41 g/mol
Molecular Formula C22H21NO5
Exact Mass 379.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4tlrAxqAqcv
Name 2-[2-[(tert-Butoxycarbonyl)aminophenyl]-5-methoxy-1,4-naphthoquinone
Alternate Name(s) tert-Butyl 2-(5-methoxy-1,4-dioxo-1,4-dihydro-2-naphthalenyl)phenylcarbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21NO5
InChI InChI=1S/C22H21NO5/c1-22(2,3)28-21(26)23-16-10-6-5-8-13(16)15-12-17(24)19-14(20(15)25)9-7-11-18(19)27-4/h5-12H,1-4H3,(H,23,26)
InChIKey JSVNJYZWMMROFF-UHFFFAOYSA-N
Molecular Weight 379.412 g/mol
SMILES N(C(OC(C)(C)C)=O)c1c(C=2C(c3cccc(c3C(C2)=O)OC)=O)cccc1
SPLASH splash10-03fr-0091000000-83decd570e46fa45489c
Source of Spectrum F-53-16842-27
Wiley ID 804777